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Conformers: ABBIImiBZICOPNSYNN
Click the Summary/Torsions/Similar/... tabs for more details.
Crystal structure of the homing endonuclease I-MsoI bound to its DNA substrate

Results of the assignment of 46 detected steps in 1 model(s), can be also downloaded as csv or json file. Average confal 0, percentile 0.

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Click a row in table or a step in viewer for analysis of results. Click column headers to sort data.
Define restraints for steps within Å cartesian RMSD, global sigma scaling factor or use per step sigma scaling.
step numberStep nameCANANtCconfalrmsd
011m5x_C_DG501_DC502BBBBB00800.21 BB00
021m5x_C_DC502_DA503BBBBB00850.18 BB00
031m5x_C_DA503_DG504BB2BB07450.25 BB07
041m5x_C_DG504_DA505BBBBB00580.31 BB00
051m5x_C_DA505_DA506BBwBB02930.12 BB02
061m5x_C_DA506_DC507BBBBB00780.21 BB00
071m5x_C_DC507_DG508BBBBB00890.18 BB00
081m5x_C_DG508_DT509BBBBB00830.24 BB00
091m5x_C_DT509_DC510BB2BB07740.38 BB07
101m5x_C_DC510_DG511BBBBB00880.22 BB00
111m5x_C_DG511_DT512miBBB12940.13 BB12
121m5x_C_DT512_DG513BBwBB16450.42 BB16
131m5x_C_DG513_DA514miBBB12940.05 BB12
141m5x_C_DA514_DG515NANNANT00.85 BB13
151m5x_C_DG515_DA516BBBBB00540.47 BB00
161m5x_C_DA516_DC517miBBB12720.28 BB12
171m5x_C_DC517_DA518BBwBB16600.48 BB16
181m5x_C_DA518_DG519BBwBB02730.17 BB02
191m5x_C_DG519_DT520BBBBB00790.19 BB00
201m5x_C_DT520_DT521BBBBB00770.27 BB00
211m5x_C_DT521_DC522BBBBB00870.17 BB00
221m5x_C_DC522_DC523BBBBB00770.30 BB00
231m5x_C_DC523_DG524B12BB04540.29 BB04
241m5x_D_DC551_DG552NANNANT00.34 BB16
251m5x_D_DG552_DG553BBBBB00680.31 BB00
261m5x_D_DG553_DA554B12BB04690.25 BB04
271m5x_D_DA554_DA555BBBBB00710.24 BB00
281m5x_D_DA555_DC556BBBBB00940.12 BB00
291m5x_D_DC556_DT557BBBBB00830.26 BB00
301m5x_D_DT557_DG558BBBBB00690.21 BB00
311m5x_D_DG558_DT559BBBBB00710.28 BB00
321m5x_D_DT559_DC560BB2BB07920.25 BB07
331m5x_D_DC560_DT561BBBBB00930.12 BB00
341m5x_D_DT561_DC562miBBB12860.18 BB12
351m5x_D_DC562_DA563BBwBB16490.41 BB16
361m5x_D_DA563_DC564miBBB12840.12 BB12
371m5x_D_DC564_DG565NANNANT00.86 BB13
381m5x_D_DG565_DA566BBwBB16700.26 BB16
391m5x_D_DA566_DC567miBBB12720.33 BB12
401m5x_D_DC567_DG568BBwBB16590.41 BB16
411m5x_D_DG568_DT569BBBBB00860.26 BB00
421m5x_D_DT569_DT570BBBBB00920.20 BB00
431m5x_D_DT570_DC571BBBBB00710.31 BB00
441m5x_D_DC571_DT572BBwBB02870.16 BB02
451m5x_D_DT572_DG573BBBBB00670.21 BB00
461m5x_D_DG573_DC574BBBBB00760.28 BB00

Steps with non-standard or missing atoms have not been assigned, description of conformers is defined in the table.
Definition of torsion angles
step:
Table of conformers

δ1ε1ζ1α2β2γ2δ2χ1χ2μNNCC
step_torsions
ntC_average
Δ torsions
torsion scores

commentsstep confal = NaN
cartesian RMSD = NaN Å
pseudorotation: NA
details: NA
Similarity of step to class averages

Download

Results as csv or json file.
Best NtC fitted to input structure.

Restraints

Restraints file for REFMAC (steps with RMSD <= 0.5Å)
Commands file for MMB (steps with RMSD <= 0.5Å)
Restraints file for Phenix (steps with RMSD <= 0.5Å) [?]

Definitions

Average parameters (csv), esd values (csv), and Cartesian coordinates of conformers.

Download the papers

Description of DNATCO server:
Černý et al., Nucleic Acids Research, 44, W284 (2016).
Definition of conformers:
Schneider et al., Acta Cryst D, 74, 52-64 (2018).
Example of application:
Schneider et al., Genes, 8(10), 278, (2017).

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